SCHEMBL9869251

SCHEMBL9869251

CCOc1ccc(-c2nsc(S(=O)(=O)N=CN3CCCC3)n2)cc1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.41
TP53 P04637 2/20 0.41
NPSR1 Q6W5P4 2/20 0.40
GAA P10253 1/20 0.40
HPGD P15428 3/20 0.38
KDM4E B2RXH2 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
ALDH1A1 P00352 5/20 0.37
LMNA P02545 2/20 0.37
GBA1 P04062 1/20 0.37
MEN1 O00255 1/20 0.37
HTT P42858 1/20 0.37
KMT2A Q03164 1/20 0.37
NPC1 O15118 3/20 0.37
FYN P06241 1/20 0.37
RAB9A P51151 1/20 0.37
HSD17B10 Q99714 1/20 0.35
TSHR P16473 1/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL9869249 1.00 MAPT (0.41) MAPTTP53NPSR1GAAHPGD
SCHEMBL9867674 0.87 ADORA3 (0.41) MAPTTP53NPSR1HPGDKDM4E
SCHEMBL9867670 0.87 ADORA3 (0.41) MAPTTP53NPSR1HPGDKDM4E
SCHEMBL9866517 0.75 CA2 (0.51) MAPTTP53NPSR1GAAHPGD
SCHEMBL9867483 0.74 MEN1 (0.49) MAPTNPSR1GAAHPGDALDH1A1
SCHEMBL9867476 0.74 MEN1 (0.49) MAPTNPSR1GAAHPGDALDH1A1
SCHEMBL9867555 0.73 TP53 (0.50) MAPTTP53NPSR1GAAHPGD
SCHEMBL9867817 0.70 ADORA3 (0.44) MAPTTP53GAAHPGDKDM4E
SCHEMBL9867775 0.66 LMNA (0.41) MAPTTP53GAAKDM4EL3MBTL1
SCHEMBL9866312 0.66 SMN1; SMN2 (0.40) MAPTTP53NPSR1L3MBTL1ALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4873239-A GLAUCOMA TREATMENT HOECHST-ROUSSEL PHARMACEUTICALS, INC. (US) 1989-10-10 US claimed
US-4985450-A TREATMENT OF GLAUCOMA AVENTIS PHARMACEUTICALS INC. 1991-01-15 US disclosed
US-4873239-A GLAUCOMA TREATMENT HOECHST-ROUSSEL PHARMACEUTICALS, INC. (US) 1989-10-10 US disclosed
EP-0276822-A1 Arylthiadiazolylsulfonamides and derivatives, a process for their preparation and their use as medicaments HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1988-08-03 EP disclosed
US-4758578-A Arylthiadiazolylsulfonamides, pharmaceutical compositions and use HOECHST ROUSSEL PHARMACEUTICALS, INC. (US) 1988-07-19 US disclosed